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CAS No.: | 42839-91-8 |
---|---|
Name: | 3-methoxy-2-methyl-fluoren-9-one |
Molecular Structure: | |
Formula: | C15H12O2 |
Molecular Weight: | 224.259 |
Synonyms: | NSC 48301;3-Methoxy-2-methyl-9H-fluoren-9-one;3-Methoxy-2-methyl-fluoren-9-one; |
Density: | 1.211 g/cm3 |
Boiling Point: | 404.6 °C at 760 mmHg |
Flash Point: | 194 °C |
PSA: | 26.30000 |
LogP: | 3.21500 |
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The 9H-Fluoren-9-one,3-methoxy-2-methyl-, with the CAS registry number 42839-91-8, is also known as 3-Methoxy-2-methyl-fluoren-9-one. This chemical's molecular formula is C15H12O2 and molecular weight is 224.25. What's more, its systematic name is 3-Methoxy-2-methyl-9H-fluoren-9-one.
Physical properties of 9H-Fluoren-9-one,3-methoxy-2-methyl- are: (1)ACD/LogP: 4.09; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.624; (8)Molar Refractivity: 65.42 cm3; (9)Molar Volume: 185.1 cm3; (10)Polarizability: 25.93×10-24 cm3; (11)Surface Tension: 47.7 dyne/cm; (12)Density: 1.211 g/cm3; (13)Flash Point: 194 °C; (14)Enthalpy of Vaporization: 65.61 kJ/mol; (15)Boiling Point: 404.6 °C at 760 mmHg; (16)Vapour Pressure: 9.32E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C3c1ccccc1c2c3cc(c(OC)c2)C
(2)InChI: InChI=1S/C15H12O2/c1-9-7-13-12(8-14(9)17-2)10-5-3-4-6-11(10)15(13)16/h3-8H,1-2H3
(3)InChIKey: HQULSBFZRSUNDA-UHFFFAOYSA-N